(6Z)-1-cyclopenta-1,3-dien-1-yl-6-propylidenecyclohexa-1,3-diene

C14H16 — CID 163899779

IUPAC(6Z)-1-cyclopenta-1,3-dien-1-yl-6-propylidenecyclohexa-1,3-diene
SMILESCC/C=C1/CC=CC=C1C1=CC=CC1
InChIInChI=1S/C14H16/c1-2-7-12-8-5-6-11-14(12)13-9-3-4-10-13/h3-7,9,11H,2,8,10H2,1H3/b12-7-
InChIKeyQIUPEJKJIAYUSF-GHXNOFRVSA-N
MW184.28 g/mol
LogP4.10
Rot. Bonds2

About (6Z)-1-cyclopenta-1,3-dien-1-yl-6-propylidenecyclohexa-1,3-diene

(6Z)-1-cyclopenta-1,3-dien-1-yl-6-propylidenecyclohexa-1,3-diene (PubChem CID 163899779) has the molecular formula C14H16 and a molecular weight of 184.28 g/mol. Its IUPAC name is (6Z)-1-cyclopenta-1,3-dien-1-yl-6-propylidenecyclohexa-1,3-diene.

Molecular Properties

Compound Name(6Z)-1-cyclopenta-1,3-dien-1-yl-6-propylidenecyclohexa-1,3-diene
PubChem CID163899779
Molecular FormulaC14H16
Molecular Weight184.28 g/mol
Exact Mass184.13
IUPAC Name(6Z)-1-cyclopenta-1,3-dien-1-yl-6-propylidenecyclohexa-1,3-diene
SMILESCC/C=C1/CC=CC=C1C1=CC=CC1
InChIInChI=1S/C14H16/c1-2-7-12-8-5-6-11-14(12)13-9-3-4-10-13/h3-7,9,11H,2,8,10H2,1H3/b12-7-
InChIKeyQIUPEJKJIAYUSF-GHXNOFRVSA-N
XLogP4.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (6Z)-1-cyclopenta-1,3-dien-1-yl-6-propylidenecyclohexa-1,3-diene?
The IUPAC name of (6Z)-1-cyclopenta-1,3-dien-1-yl-6-propylidenecyclohexa-1,3-diene (CID 163899779) is (6Z)-1-cyclopenta-1,3-dien-1-yl-6-propylidenecyclohexa-1,3-diene.
What is the SMILES notation for (6Z)-1-cyclopenta-1,3-dien-1-yl-6-propylidenecyclohexa-1,3-diene?
The canonical SMILES for (6Z)-1-cyclopenta-1,3-dien-1-yl-6-propylidenecyclohexa-1,3-diene is CC/C=C1/CC=CC=C1C1=CC=CC1.
What is the InChIKey of (6Z)-1-cyclopenta-1,3-dien-1-yl-6-propylidenecyclohexa-1,3-diene?
The InChIKey is QIUPEJKJIAYUSF-GHXNOFRVSA-N. The full InChI is InChI=1S/C14H16/c1-2-7-12-8-5-6-11-14(12)13-9-3-4-10-13/h3-7,9,11H,2,8,10H2,1H3/b12-7-.
What are the key properties of (6Z)-1-cyclopenta-1,3-dien-1-yl-6-propylidenecyclohexa-1,3-diene?
(6Z)-1-cyclopenta-1,3-dien-1-yl-6-propylidenecyclohexa-1,3-diene has a molecular weight of 184.28 g/mol, XLogP of 4.10, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-1-cyclopenta-1,3-dien-1-yl-6-propylidenecyclohexa-1,3-diene is sourced from PubChem (CID 163899779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).